4-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-benzoic acid

Systemtic Name: 4-bromanyl-2-(2-ethoxy-2-oxidanylidene-ethyl)-5-methyl-benzoic acid Openeye Name: 4-bromo-2-(2-ethoxy-2-oxo-ethyl)-5-methyl-benzoic acid CAS Name: 4-bromo-2-(2-ethoxy-2-oxoethyl)-5-methylbenzoic acid IUPAC Name: 4-bromo-2-(2-ethoxy-2-oxoethyl)-5-methylbenzoic acid Traditional Name: 4-bromo-2-(2-ethoxy-2-keto-ethyl)-5-methyl-benzoic acid Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC(=C(C=C1C(=O)O)C)Br

Isomeric SMILES

CCOC(=O)CC1=CC(=C(C=C1C(=O)O)C)Br

InChI

InChI=1S/C12H13BrO4/c1-3-17-11(14)6-8-5-10(13)7(2)4-9(8)12(15)16/h4-5H,3,6H2,1-2H3,(H,15,16)